| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 18th, 2010 | 27 | No |
Popular Name: (4-isobutylphenyl)-[1-(2-thioxo-1H-pyridine-3-carbonyl)-4-piperidyl]methanone (4-isobutylphenyl)-[1-(2-thioxo-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.57 | 11.17 | -71.19 | 0 | 4 | -1 | 50 | 381.521 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | 11.6 | -42.47 | 1 | 4 | 0 | 53 | 382.529 | 5 | ↓ |
